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© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

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forcefield mm+
sys 0 0 1
view 40 0.082455 65.2 25.2 0.5925853 0.1634324 -0.7887538 0.2368915 0.9005395 0.3645697 0.7698864 -0.4028878 0.4949307 -0.58557 3.778 -63.762
seed 0
mol 1
atom 1 - C ** - -0.06177139 3.6657 -0.3244 -0.268 3 2 d 6 s 36 s
atom 2 - C ** - -0.2145514 3.3709 1.1797 -0.6241 3 1 d 3 s 16 s
atom 3 - C ** - 0.1732235 4.6613 2.3256 -0.736 4 2 s 4 s 25 s 26 s
atom 4 - C ** - 0.1178999 6.1276 0.6991 -2.078199 4 3 s 5 s 7 s 8 s
atom 5 - C ** - -0.1164274 6.3381 -1.0474 -1.4779 2 4 s 6 s
atom 6 - C ** - 0.1717806 5.0772 -1.4747 -0.437 3 1 s 5 s 17 s
atom 7 - O ** - -0.3584433 7.5409 1.1892 -2.204 1 4 s
atom 8 - C ** - 0.1632471 5.5537 0.5189 -3.6311 3 4 s 9 s 32 s
atom 9 - C ** - -0.08497763 5.1689 2.222 -3.5852 3 8 s 10 s 14 s
atom 10 - C ** - 0.1310046 6.0711 2.8167 -4.728 4 9 s 11 s 28 s 56 s
atom 11 - C ** - 0.06876945 6.0253 4.4876 -5.133 3 10 s 12 s 27 s
atom 12 - C ** - -0.02408171 4.8246 5.6027 -4.027599 2 11 s 13 s
atom 13 - C ** - 0.0587306 3.1427 4.7487 -4.0697 3 12 s 14 s 33 s
atom 14 - C ** - 0.08437037 3.197 2.8573 -3.8243 4 9 s 13 s 15 s 62 s
atom 15 - C ** - 0.167377 2.0051 2.8135 -2.1726 3 14 s 16 s 34 d
atom 16 - C ** - 0.1994212 1.8212 1.9068 -0.7537 3 2 s 15 s 35 s
atom 17 - O ** - -0.2882042 5.6121 -1.841899 0.8858 2 6 s 18 s
atom 18 - C ** - 0.3576517 4.8473 -2.9028 1.561599 3 17 s 19 s 37 d
atom 19 - C ** - 0.05360174 4.5302 -2.6751 3.0218 3 18 s 20 s 38 s
atom 20 - C ** - 0.05823064 3.0383 -3.277 3.453 3 19 s 21 s 22 s
atom 21 - C ** - -0.1108565 3.0851 -3.7223 5.0038 3 20 s 40 d 44 s
atom 22 - N ** - -0.1006403 1.9558 -2.1612 3.4494 2 20 s 23 s
atom 23 - C ** - 0.2302809 0.5843 -2.5109 3.5868 3 22 s 24 s 39 d
atom 24 - C ** - -0.09393167 -0.603 -1.492999 3.9332 2 23 s 57 s
atom 25 - C ** - -0.1064258 4.4012 3.442 1.2419 1 3 s
atom 26 - C ** - -0.182693 4.3022 4.1715 -1.4099 1 3 s
atom 27 - O ** - -0.3035765 7.6008 4.4774 -4.9206 2 11 s 56 s
atom 28 - O ** - -0.5151463 5.3363 1.6739 -5.6822 2 10 s 29 s
atom 29 - C ** - 0.3814421 5.0169 0.7326 -6.9315 3 28 s 30 s 31 d
atom 30 - C ** - -0.06813669 3.8594 -0.5349 -7.1017 1 29 s
atom 31 - O ** - -0.3399658 5.6045 0.9857 -7.9631 1 29 d
atom 32 - O ** - -0.4141493 4.3388 -0.4225 -3.523 2 8 s 45 s
atom 33 - O ** - -0.3490138 2.3085 5.1614 -5.233 1 13 s
atom 34 - O ** - -0.3414345 1.1699 3.7233 -2.0727 1 15 d
atom 35 - O ** - -0.4030118 0.4678 0.9105 -0.8487 2 16 s 53 s
atom 36 - C ** - -0.1149845 2.4031 -1.2644 0.3714 1 1 s
atom 37 - O ** - -0.2982144 4.5924 -3.968099 1.025099 1 18 d
atom 38 - O ** - -0.3005762 5.6459 -3.4657 3.5932 1 19 s
atom 39 - O ** - -0.3923483 0.2852 -3.6707 3.3108 1 23 d
atom 40 - C ** - -0.07689047 2.2071 -4.6919 5.5147 2 21 d 41 s
atom 41 - C ** - -0.1022797 2.0527 -4.8664 6.886 2 40 s 42 d
atom 42 - C ** - -0.1015244 3.0636 -4.4517 7.7216 2 41 d 43 s
atom 43 - C ** - -0.09804535 4.1704 -3.735999 7.2176 2 42 s 44 d
atom 44 - C ** - -0.1056566 4.0686 -3.1891 5.9407 2 21 s 43 d
atom 45 - C ** - 0.3496594 3.186 -1.1956 -4.3101 3 32 s 46 s 52 d
atom 46 - C ** - 0.1048651 1.3255 -1.1623 -4.8696 3 45 s 47 d 51 s
atom 47 - C ** - -0.1065989 0.6905 -1.1065 -5.7692 2 46 d 48 s
atom 48 - C ** - -0.135684 -0.1895 -2.1964 -5.5018 2 47 s 49 d
atom 49 - C ** - -0.08887005 -0.7749 -2.5463 -4.2377 2 48 d 50 s
atom 50 - C ** - -0.1784344 -0.6102 -1.6907 -3.2031 2 49 s 51 d
atom 51 - C ** - -0.0967164 0.7002 -1.1144 -3.1691 2 46 s 50 d
atom 52 - O ** - -0.3155413 3.6385 -2.3101 -4.512399 1 45 d
atom 53 - C ** - 0.3789926 -0.9607 0.8414 -0.0146 3 35 s 54 s 55 d
atom 54 - C ** - -0.05844307 -2.1466 -0.3323 -0.1942 1 53 s
atom 55 - O ** - -0.3219595 -1.1572 1.635 0.8976 1 53 d
atom 56 - C ** - 0.06595802 7.8102 2.9025 -4.5808 2 10 s 27 s
atom 57 - C ** - -0.09751797 -1.9832 -2.1924 3.3257 2 24 s 58 s
atom 58 - C ** - -0.1068335 -3.2872 -1.3083 3.6073 2 57 s 59 s
atom 59 - C ** - -0.127152 -4.4433 -2.3917 3.2356 2 58 s 60 s
atom 60 - C ** - -0.08844328 -5.8649 -2.067699 3.6162 2 59 s 61 s
atom 61 - C ** - -0.1222763 -6.4864 -3.6297 3.1978 1 60 s
atom 62 - C ** - -0.1164832 2.4154 1.9334 -5.2167 1 14 s
endmol 1